cyclohexyl-[3-[[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonylamino]propyl]-methyl-azanium

Systemtic Name: cyclohexyl-[3-[[2-(3,4-dimethylphenyl)quinolin-4-yl]carbonylamino]propyl]-methyl-azanium Openeye Name: cyclohexyl-[3-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]propyl]-methyl-ammonium CAS Name: cyclohexyl-[3-[[[2-(3,4-dimethylphenyl)-4-quinolinyl]-oxomethyl]amino]propyl]-methylammonium IUPAC Name: cyclohexyl-[3-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]propyl]-methylazanium Traditional Name: cyclohexyl-[3-[[2-(3,4-dimethylphenyl)quinoline-4-carbonyl]amino]propyl]-methyl-ammonium Formula: C28H36N3O+ MolecularWeight: 430.60494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC[NH+](C)C4CCCCC4)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCC[NH+](C)C4CCCCC4)C

InChI

InChI=1S/C28H35N3O/c1-20-14-15-22(18-21(20)2)27-19-25(24-12-7-8-13-26(24)30-27)28(32)29-16-9-17-31(3)23-10-5-4-6-11-23/h7-8,12-15,18-19,23H,4-6,9-11,16-17H2,1-3H3,(H,29,32)/p+1